Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | CMA1 | P23946 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.35 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 5/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 4/20 | 0.34 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27738748 | 0.83 | CYP19A1 (0.41) | KDM4EALDH1A1MTNR1AMTNR1BCYP19A1 | |
| SCHEMBL27919840 | 0.83 | CYP19A1 (0.46) | KDM4EALDH1A1CYP19A1GSK3BGSK3A | |
| SCHEMBL27487576 | 0.80 | ALDH1A1 (0.50) | KDM4EALDH1A1MEN1NPC1POLB | |
| SCHEMBL21661970 | 0.79 | KDM4E (0.54) | KDM4EALDH1A1MEN1NPC1USP2 | |
| SCHEMBL27729418 | 0.77 | LMNA (0.52) | KDM4EALDH1A1MEN1POLBKMT2A | |
| SCHEMBL27751837 | 0.76 | CYP19A1 (0.41) | KDM4EALDH1A1MEN1POLBKMT2A | |
| SCHEMBL27749453 | 0.75 | HRH2 (0.37) | KDM4EALDH1A1CYP19A1GSK3BPIM1 | |
| SCHEMBL27570408 | 0.75 | ALDH1A1 (0.37) | ALDH1A1MEN1NPC1USP2POLB | |
| SCHEMBL8360748 | 0.75 | KDM4E (0.50) | KDM4EALDH1A1MEN1NPC1USP2 | |
| SCHEMBL1092202 | 0.71 | ALDH1A1 (1.00) | KDM4EALDH1A1MEN1NPC1USP2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103889224-A | ANTIBACTERIAL COMPOUNDS AND METHODS FOR USE | PTC THERAPEUTICS INC | 2014-06-25 | — | — | CN | disclosed |
| CN-1197860-C | FAB I inhibitors | SMITHKLINE BEECHAM CORP (CA) | 2005-04-20 | — | — | CN | disclosed |
| CN-1378542-A | Antigen binding fragment I inhibitors | SMITHKLINE BEECHAM CORP (US) | 2002-11-06 | — | — | CN | disclosed |